N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine

C96H77BrF15N17O21 — CID 167549818

IUPACN,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine
SMILESCN(O)C(=O)c1ncc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cc1O.COC(=O)c1ncc(Br)cc1OC.COC(=O)c1ncc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cc1OC.COc1cc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cnc1C(=O)O.COc1ccc(CON(C)C(=O)c2ncc(Nc3ncc(-c4ccc(C(F)(F)F)cc4)o3)cc2OC)cc1.Nc1ncc(-c2ccc(C(F)(F)F)cc2)o1
InChIInChI=1S/C26H23F3N4O5.C18H14F3N3O4.C17H13F3N4O4.C17H12F3N3O4.C10H7F3N2O.C8H8BrNO3/c1-33(37-15-16-4-10-20(35-2)11-5-16)24(34)23-21(36-3)12-19(13-30-23)32-25-31-14-22(38-25)17-6-8-18(9-7-17)26(27,28)29;1-26-13-7-12(8-22-15(13)16(25)27-2)24-17-23-9-14(28-17)10-3-5-11(6-4-10)18(19,20)21;1-24(27)15(26)14-12(25)6-11(7-21-14)23-16-22-8-13(28-16)9-2-4-10(5-3-9)17(18,19)20;1-26-12-6-11(7-21-14(12)15(24)25)23-16-22-8-13(27-16)9-2-4-10(5-3-9)17(18,19)20;11-10(12,13)7-3-1-6(2-4-7)8-5-15-9(14)16-8;1-12-6-3-5(9)4-10-7(6)8(11)13-2/h4-14H,15H2,1-3H3,(H,31,32);3-9H,1-2H3,(H,23,24);2-8,25,27H,1H3,(H,22,23);2-8H,1H3,(H,22,23)(H,24,25);1-5H,(H2,14,15);3-4H,1-2H3
InChIKeyCGIXZQCVOMVHLL-UHFFFAOYSA-N
MW2169.64 g/mol
LogP22.47
Rot. Bonds26

About N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine

N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine (PubChem CID 167549818) has the molecular formula C96H77BrF15N17O21 and a molecular weight of 2169.64 g/mol. Its IUPAC name is N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine.

Molecular Properties

Compound NameN,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine
PubChem CID167549818
Molecular FormulaC96H77BrF15N17O21
Molecular Weight2169.64 g/mol
Exact Mass2167.44
IUPAC NameN,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine
SMILESCN(O)C(=O)c1ncc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cc1O.COC(=O)c1ncc(Br)cc1OC.COC(=O)c1ncc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cc1OC.COc1cc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cnc1C(=O)O.COc1ccc(CON(C)C(=O)c2ncc(Nc3ncc(-c4ccc(C(F)(F)F)cc4)o3)cc2OC)cc1.Nc1ncc(-c2ccc(C(F)(F)F)cc2)o1
InChIInChI=1S/C26H23F3N4O5.C18H14F3N3O4.C17H13F3N4O4.C17H12F3N3O4.C10H7F3N2O.C8H8BrNO3/c1-33(37-15-16-4-10-20(35-2)11-5-16)24(34)23-21(36-3)12-19(13-30-23)32-25-31-14-22(38-25)17-6-8-18(9-7-17)26(27,28)29;1-26-13-7-12(8-22-15(13)16(25)27-2)24-17-23-9-14(28-17)10-3-5-11(6-4-10)18(19,20)21;1-24(27)15(26)14-12(25)6-11(7-21-14)23-16-22-8-13(28-16)9-2-4-10(5-3-9)17(18,19)20;1-26-12-6-11(7-21-14(12)15(24)25)23-16-22-8-13(27-16)9-2-4-10(5-3-9)17(18,19)20;11-10(12,13)7-3-1-6(2-4-7)8-5-15-9(14)16-8;1-12-6-3-5(9)4-10-7(6)8(11)13-2/h4-14H,15H2,1-3H3,(H,31,32);3-9H,1-2H3,(H,23,24);2-8,25,27H,1H3,(H,22,23);2-8H,1H3,(H,22,23)(H,24,25);1-5H,(H2,14,15);3-4H,1-2H3
InChIKeyCGIXZQCVOMVHLL-UHFFFAOYSA-N
XLogP22.47
TPSA495.10 Ų
H-Bond Donors8
H-Bond Acceptors35
Rotatable Bonds26
Heavy Atoms150
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002169.64
LogP ≤ 522.47
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1035

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine with MolForge

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Related Compounds

N,3-dihydroxy-N-methyl-5-[[5-(4-methylphenyl)-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide
CID 167627830
3-methoxy-5-[(5-methyl-1,3-oxazol-2-yl)amino]pyridine-2-carboxylic acid
CID 155585490
5-[4-[2-(dimethylamino)ethoxy]phenyl]-N-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine
CID 156506688
4-[2-(3-methoxyanilino)-1,3-oxazol-5-yl]benzoic acid
CID 166108179
methyl 3-[2-[4-(trifluoromethyl)anilino]-1,3-oxazol-5-yl]benzoate
CID 139441273
2-(4-methoxyphenyl)-5-[4-(trifluoromethyl)phenyl]-1,3-oxazole
CID 102345414
N-(2-hydroxyethyl)-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid
CID 167597183
N',3-dihydroxy-5-[[5-(4-methylphenyl)-1,3-oxazol-2-yl]amino]pyridine-2-carboximidamide
CID 172965921
methyl 3-methoxy-5-(trifluoromethyl)pyridine-2-carboxylate
CID 121231628
1-hydroxy-6-methyl-4-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridin-2-one
CID 155585257
ethyl 2-methoxy-4-[(5-phenyl-1,3-oxazol-2-yl)amino]benzoate
CID 139225247
5-hydroxy-2-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]-1H-pyridin-4-one
CID 155585282

Frequently Asked Questions

What is the IUPAC name of N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine?
The IUPAC name of N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine (CID 167549818) is N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine.
What is the SMILES notation for N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine?
The canonical SMILES for N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine is CN(O)C(=O)c1ncc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cc1O.COC(=O)c1ncc(Br)cc1OC.COC(=O)c1ncc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cc1OC.COc1cc(Nc2ncc(-c3ccc(C(F)(F)F)cc3)o2)cnc1C(=O)O.COc1ccc(CON(C)C(=O)c2ncc(Nc3ncc(-c4ccc(C(F)(F)F)cc4)o3)cc2OC)cc1.Nc1ncc(-c2ccc(C(F)(F)F)cc2)o1.
What is the InChIKey of N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine?
The InChIKey is CGIXZQCVOMVHLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23F3N4O5.C18H14F3N3O4.C17H13F3N4O4.C17H12F3N3O4.C10H7F3N2O.C8H8BrNO3/c1-33(37-15-16-4-10-20(35-2)11-5-16)24(34)23-21(36-3)12-19(13-30-23)32-25-31-14-22(38-25)17-6-8-18(9-7-17)26(27,28)29;1-26-13-7-12(8-22-15(13)16(25)27-2)24-17-23-9-14(28-17)10-3-5-11(6-4-10)18(19,20)21;1-24(27)15(26)14-12(25)6-11(7-21-14)23-16-22-8-13(28-16)9-2-4-10(5-3-9)17(18,19)20;1-26-12-6-11(7-21-14(12)15(24)25)23-16-22-8-13(27-16)9-2-4-10(5-3-9)17(18,19)20;11-10(12,13)7-3-1-6(2-4-7)8-5-15-9(14)16-8;1-12-6-3-5(9)4-10-7(6)8(11)13-2/h4-14H,15H2,1-3H3,(H,31,32);3-9H,1-2H3,(H,23,24);2-8,25,27H,1H3,(H,22,23);2-8H,1H3,(H,22,23)(H,24,25);1-5H,(H2,14,15);3-4H,1-2H3.
What are the key properties of N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine?
N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine has a molecular weight of 2169.64 g/mol, XLogP of 22.47, 26 rotatable bonds, 8 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dihydroxy-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-N-[(4-methoxyphenyl)methoxy]-N-methyl-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxamide;3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylic acid;methyl 5-bromo-3-methoxypyridine-2-carboxylate;methyl 3-methoxy-5-[[5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-yl]amino]pyridine-2-carboxylate;5-[4-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine is sourced from PubChem (CID 167549818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).